SCHEMBL18403239

SCHEMBL18403239

Cc1cc(C2CCOC2)[nH]n1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.38
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
HCAR2 Q8TDS4 3/20 0.34
PDE2A O00408 1/20 0.33
GSK3A P49840 3/20 0.33
GSK3B P49841 3/20 0.33
LRRK2 Q5S007 3/20 0.33
PIK3C3 Q8NEB9 1/20 0.33
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 1/20 0.32
PRKAG2 Q9UGJ0 1/20 0.32
PRKAB1 Q9Y478 1/20 0.32
IGF1R P08069 3/20 0.32
HCAR3 P49019 1/20 0.32
PIM1 P11309 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19296055 0.89 DAO (0.47) DAOHCAR2GSK3AGSK3BLRRK2
SCHEMBL14930342 0.85 HCAR2 (0.34) HCAR2GSK3BIGF1RHCAR3PIM1
SCHEMBL15882695 0.79 DAO (0.38) DAOPRMT5WDR77HCAR2LRRK2
SCHEMBL29327043 0.79 PRMT5 (0.40) DAOPRMT5WDR77HCAR2PIK3C3
SCHEMBL14722728 0.79 PRMT5 (0.40) DAOPRMT5WDR77HCAR2PIK3C3
SCHEMBL255129 0.79
SCHEMBL17412844 0.76 HCAR2 (0.53) DAOHCAR2IGF1RHCAR3
SCHEMBL15834440 0.76 HCAR2 (0.49) DAOHCAR2IGF1RHCAR3
SCHEMBL17412842 0.74 HCAR2 (0.47) DAOHCAR2IGF1RHCAR3
SCHEMBL16845845 0.73 MKNK1 (0.53) HCAR2IGF1R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed
US-10028942-B2 3-substituted pyrazoles and uses thereof GENENTECH, INC. (US) 2018-07-24 US disclosed
EP-2945938-B1 3-SUBSTITUTED PYRAZOLES AND USE AS DLK INHIBITORS HOFFMANN LA ROCHE (CH) 2018-03-07 EP disclosed
US-20170087137-A1 3-SUBSTITUTED PYRAZOLES AND USES THEREOF GENENTECH, INC. (US) 2017-03-30 US disclosed
US-9550777-B2 3-substituted pyrazoles and use as DLK inhibitors GENENTECH, INC. (US) 2017-01-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170087137-A1 3-SUBSTITUTED PYRAZOLES AND USES THEREOF PDXK, NLK, PDK3 DAO 1228/4885PRMT5 28/4885WDR77 554/4885
US-10028942-B2 3-substituted pyrazoles and uses thereof PDXK, NLK, PDK3 DAO 1228/4885PRMT5 28/4885WDR77 554/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.